Chemical Properties of Methanone, phenyl-2-pyridinyl- (CAS 91-02-1)

InChI

InChI=1S/C12H9NO/c14-12(10-6-2-1-3-7-10)11-8-4-5-9-13-11/h1-9H

InChI Key

GCSHUYKULREZSJ-UHFFFAOYSA-N

Formula

C12H9NO

SMILES

O=C(c1ccccc1)c1ccccn1

Molecular Weight¹

183.21

CAS

91-02-1

Other Names

• Ketone, phenyl 2-pyridyl
• Phenyl 2-pyridyl ketone
• 2-Benzoylpyridine
• Pyridine, 2-benzoyl-

• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	[9.06; 9.10]	eV
IE	9.06	eV	NIST
IE	9.06	eV	NIST
IE	9.10 ± 0.10	eV	NIST
log10WS	-3.20		Crippen Calculated Property
logPoct/wat	2.313		Crippen Calculated Property
McVol	143.970	ml/mol	McGowan Calculated Property
Tboil	[590.00; 590.20]	K
Tboil	590.20	K	NIST
Tboil	590.00	K	NIST
Tfus	316.00 ± 1.00	K	NIST

Temperature Dependent Properties

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[444.00; 444.20]	K	[1.30; 1.30]
Tboilr	444.20	K	1.30	NIST
Tboilr	444.00 ± 1.00	K	1.30	NIST

Similar Compounds

Find more compounds similar to Methanone, phenyl-2-pyridinyl-.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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